# generated using pymatgen
data_Li3NiN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.23322700
_cell_length_b   9.50691119
_cell_length_c   9.50691041
_cell_angle_alpha   89.99999480
_cell_angle_beta   125.26438760
_cell_angle_gamma   54.73561574
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3NiN2
_chemical_formula_sum   'Li24 Ni8 N16'
_cell_volume   429.62380892
_cell_formula_units_Z   8
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.22661200  0.02911600  0.98426600  1.0
  Li  Li1  1  0.77338800  0.75572800  0.51573400  1.0
  Li  Li2  1  0.77338800  0.47088400  0.75765300  1.0
  Li  Li3  1  0.22661200  0.74427200  0.74234700  1.0
  Li  Li4  1  0.25808100  0.75765300  0.27146200  1.0
  Li  Li5  1  0.74191900  0.74234700  0.01338100  1.0
  Li  Li6  1  0.25808100  0.98426600  0.48661900  1.0
  Li  Li7  1  0.74191900  0.51573400  0.22853800  1.0
  Li  Li8  1  0.71515800  0.01338100  0.74427200  1.0
  Li  Li9  1  0.71515800  0.27146200  0.47088400  1.0
  Li  Li10  1  0.28484200  0.22853800  0.75572800  1.0
  Li  Li11  1  0.28484200  0.48661900  0.02911600  1.0
  Li  Li12  1  0.77338800  0.97088400  0.01573400  1.0
  Li  Li13  1  0.22661200  0.24427200  0.48426600  1.0
  Li  Li14  1  0.22661200  0.52911600  0.24234700  1.0
  Li  Li15  1  0.77338800  0.25572800  0.25765300  1.0
  Li  Li16  1  0.74191900  0.24234700  0.72853800  1.0
  Li  Li17  1  0.25808100  0.25765300  0.98661900  1.0
  Li  Li18  1  0.74191900  0.01573400  0.51338100  1.0
  Li  Li19  1  0.25808100  0.48426600  0.77146200  1.0
  Li  Li20  1  0.28484200  0.98661900  0.25572800  1.0
  Li  Li21  1  0.28484200  0.72853800  0.52911600  1.0
  Li  Li22  1  0.71515800  0.77146200  0.24427200  1.0
  Li  Li23  1  0.71515800  0.51338100  0.97088400  1.0
  Ni  Ni24  1  0.23352200  0.00000000  0.73352200  1.0
  Ni  Ni25  1  0.76647800  0.73352200  0.76647800  1.0
  Ni  Ni26  1  0.76647800  0.50000000  0.50000000  1.0
  Ni  Ni27  1  0.23352200  0.76647800  0.00000000  1.0
  Ni  Ni28  1  0.76647800  0.00000000  0.26647800  1.0
  Ni  Ni29  1  0.23352200  0.26647800  0.23352200  1.0
  Ni  Ni30  1  0.23352200  0.50000000  0.50000000  1.0
  Ni  Ni31  1  0.76647800  0.23352200  0.00000000  1.0
  N  N32  1  0.00000000  0.00000000  0.50000000  1.0
  N  N33  1  0.00000000  0.50000000  0.00000000  1.0
  N  N34  1  0.00000000  0.50000000  0.50000000  1.0
  N  N35  1  0.00000000  0.00000000  0.00000000  1.0
  N  N36  1  0.50000000  0.97111200  0.75000000  1.0
  N  N37  1  0.50000000  0.52888800  0.25000000  1.0
  N  N38  1  0.00000000  0.25000000  0.72111200  1.0
  N  N39  1  0.00000000  0.75000000  0.77888800  1.0
  N  N40  1  0.55777600  0.72111200  0.52888800  1.0
  N  N41  1  0.44222400  0.77888800  0.97111200  1.0
  N  N42  1  0.50000000  0.02888800  0.25000000  1.0
  N  N43  1  0.50000000  0.47111200  0.75000000  1.0
  N  N44  1  0.00000000  0.75000000  0.27888800  1.0
  N  N45  1  0.00000000  0.25000000  0.22111200  1.0
  N  N46  1  0.44222400  0.27888800  0.47111200  1.0
  N  N47  1  0.55777600  0.22111200  0.02888800  1.0